KEGG   DRUG: Fruquintinib
Entry
D11977                      Drug                                   
Name
Fruquintinib (JAN/USAN);
Fruzaqla (TN)
Product
FRUZAQLA (Takeda Pharmaceuticals America)
Formula
C21H19N3O5
Exact mass
393.1325
Mol weight
393.3927
Structure
Class
Antineoplastic
 DG01918  Tyrosine kinase inhibitor
  DG01917  Receptor tyrosine kinase inhibitor
Metabolizing enzyme substrate
 DG02918  CYP2C8 substrate
 DG01642  CYP2C9 substrate
 DG01639  CYP2C19 substrate
 DG01633  CYP3A/CYP3A4 substrate
Remark
ATC code: L01EK04
Product: D11977<US>
Efficacy
Antineoplastic, Receptor tyrosine kinase inhibitor
  Disease
Colorectal cancer [DS:H00020]
Target
VEGFR1 (FLT1) [HSA:2321] [KO:K05096]
VEGFR2 (KDR) [HSA:3791] [KO:K05098]
VEGFR3 (FLT4) [HSA:2324] [KO:K05097]
  Pathway
hsa04010  MAPK signaling pathway
hsa04151  PI3K-Akt signaling pathway
hsa04510  Focal adhesion
Metabolism
Enzyme: CYP3A [HSA:1576 1577 1551]; CYP2C8 [HSA:1558], CYP2C9 [HSA:1559], CYP2C19 [HSA:1557]
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01E PROTEIN KINASE INHIBITORS
    L01EK Vascular endothelial growth factor receptor (VEGFR) tyrosine kinase inhibitors
     L01EK04 Fruquintinib
      D11977  Fruquintinib (JAN/USAN) <US>
Drug groups [BR:br08330]
 Antineoplastic
  DG01918  Tyrosine kinase inhibitor
   DG01917  Receptor tyrosine kinase inhibitor
    D11977  Fruquintinib
 Metabolizing enzyme substrate
  DG02918  CYP2C8 substrate
   D11977  Fruquintinib
  DG01642  CYP2C9 substrate
   D11977  Fruquintinib
  DG01639  CYP2C19 substrate
   D11977  Fruquintinib
  DG01633  CYP3A/CYP3A4 substrate
   D11977  Fruquintinib
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Receptor tyrosine kinases (RTK)
   VEGFR family
    VEGFR1 (FLT1)
     D11977  Fruquintinib (JAN/USAN) <US>
    VEGFR2 (KDR)
     D11977  Fruquintinib (JAN/USAN) <US>
    VEGFR3 (FLT4)
     D11977  Fruquintinib (JAN/USAN) <US>
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D11977
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D11977
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D11977
Pharmacogenomic biomarkers [br08341.html]
 Somatic variations in targeted cancer therapies
  D11977
Other DBs
CAS: 1194506-26-7
ChEBI: 229221
LinkDB
KCF data

ATOM        29
            1   C8y C    32.4100   -9.6600
            2   C8y C    32.4100  -11.0600
            3   C8y C    31.2200  -11.7600
            4   N5x N    30.0300  -11.0600
            5   C8x C    30.0300   -9.6600
            6   N5x N    31.2200   -8.9600
            7   C8x C    33.6700   -8.9600
            8   C8y C    34.8600   -9.6600
            9   C8y C    34.8600  -11.0600
            10  C8x C    33.6700  -11.7600
            11  O2a O    36.0500   -8.9600
            12  C1a C    37.3100   -9.5900
            13  O2a O    36.0500  -11.7600
            14  C1a C    37.3100  -11.0600
            15  O2a O    31.2200  -13.1600
            16  C8y C    32.4100  -13.8600
            17  C8x C    32.4100  -15.2600
            18  C8x C    33.6000  -15.9600
            19  C8y C    34.8600  -15.2600
            20  C8y C    34.8600  -13.8600
            21  C8x C    33.6000  -13.1600
            22  C8y C    36.1900  -15.6800
            23  C8y C    36.9600  -14.5600
            24  O2x O    36.1900  -13.4400
            25  C1a C    38.3600  -14.5600
            26  C5a C    36.5400  -17.0100
            27  N1b N    37.8700  -17.2900
            28  O5a O    35.6300  -18.0600
            29  C1a C    38.8500  -16.2400
BOND        32
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    2  10 1
            12    8  11 1
            13   11  12 1
            14    9  13 1
            15   13  14 1
            16    3  15 1
            17   16  17 2
            18   17  18 1
            19   18  19 2
            20   19  20 1
            21   20  21 2
            22   16  21 1
            23   19  22 1
            24   22  23 2
            25   23  24 1
            26   20  24 1
            27   23  25 1
            28   22  26 1
            29   26  27 1
            30   26  28 2
            31   27  29 1
            32   16  15 1

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